UCSF

ZINC19420989

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 12 No

Popular Name: 1-methoxy-4-(2-sulfanylethoxy)benzene 1-methoxy-4-(2-sulfanylethoxy)be…

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CAS Number: 649739-49-1

Other Names:

MFCD09804576

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.37 4.31 -4.06 0 2 0 18 184.26 4 ↓
Hi High (pH 8-9.5) 2.37 4.79 -41.45 0 2 -1 18 183.252 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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